N-[4-oxidanylidene-4-[(3-pyrrolidin-1-ylcarbonylphenyl)methylamino]butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[(3-pyrrolidin-1-ylcarbonylphenyl)methylamino]butyl]thiophene-2-carboxamide Openeye Name: N-[4-oxo-4-[[3-(pyrrolidine-1-carbonyl)phenyl]methylamino]butyl]thiophene-2-carboxamide CAS Name: N-[4-oxo-4-[[3-[oxo(1-pyrrolidinyl)methyl]phenyl]methylamino]butyl]-2-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[[3-(pyrrolidine-1-carbonyl)phenyl]methylamino]butyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[[3-(pyrrolidine-1-carbonyl)benzyl]amino]butyl]thiophene-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CC=C2)CNC(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CC=C2)CNC(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C21H25N3O3S/c25-19(9-4-10-22-20(26)18-8-5-13-28-18)23-15-16-6-3-7-17(14-16)21(27)24-11-1-2-12-24/h3,5-8,13-14H,1-2,4,9-12,15H2,(H,22,26)(H,23,25)